4-isothiocyanato-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide

Systemtic Name: 4-isothiocyanato-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Openeye Name: 4-isothiocyanato-N-(5-methylisoxazol-3-yl)benzenesulfonamide CAS Name: 4-isothiocyanato-N-(5-methyl-3-isoxazolyl)benzenesulfonamide IUPAC Name: 4-isothiocyanato-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Traditional Name: 4-isothiocyanato-N-(5-methylisoxazol-3-yl)benzenesulfonamide Formula: C11H9N3O3S2 MolecularWeight: 295.33746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C11H9N3O3S2/c1-8-6-11(13-17-8)14-19(15,16)10-4-2-9(3-5-10)12-7-18/h2-6H,1H3,(H,13,14)